(3R)-3-(cyclopropylmethoxy)-1-piperidin-4-yl-1-azaspiro[3.5]nonan-2-one

C17H28N2O2 — CID 99728085

IUPAC(3R)-3-(cyclopropylmethoxy)-1-piperidin-4-yl-1-azaspiro[3.5]nonan-2-one
SMILESO=C1[C@H](OCC2CC2)C2(CCCCC2)N1C1CCNCC1
InChIInChI=1S/C17H28N2O2/c20-16-15(21-12-13-4-5-13)17(8-2-1-3-9-17)19(16)14-6-10-18-11-7-14/h13-15,18H,1-12H2/t15-/m0/s1
InChIKeyYNPAUOPLPOQNMZ-HNNXBMFYSA-N
MW292.42 g/mol
LogP2.08
Rot. Bonds4

About (3R)-3-(cyclopropylmethoxy)-1-piperidin-4-yl-1-azaspiro[3.5]nonan-2-one

(3R)-3-(cyclopropylmethoxy)-1-piperidin-4-yl-1-azaspiro[3.5]nonan-2-one (PubChem CID 99728085) has the molecular formula C17H28N2O2 and a molecular weight of 292.42 g/mol. Its IUPAC name is (3R)-3-(cyclopropylmethoxy)-1-piperidin-4-yl-1-azaspiro[3.5]nonan-2-one.

Molecular Properties

Compound Name(3R)-3-(cyclopropylmethoxy)-1-piperidin-4-yl-1-azaspiro[3.5]nonan-2-one
PubChem CID99728085
Molecular FormulaC17H28N2O2
Molecular Weight292.42 g/mol
Exact Mass292.22
IUPAC Name(3R)-3-(cyclopropylmethoxy)-1-piperidin-4-yl-1-azaspiro[3.5]nonan-2-one
SMILESO=C1[C@H](OCC2CC2)C2(CCCCC2)N1C1CCNCC1
InChIInChI=1S/C17H28N2O2/c20-16-15(21-12-13-4-5-13)17(8-2-1-3-9-17)19(16)14-6-10-18-11-7-14/h13-15,18H,1-12H2/t15-/m0/s1
InChIKeyYNPAUOPLPOQNMZ-HNNXBMFYSA-N
XLogP2.08
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.42
LogP ≤ 52.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze (3R)-3-(cyclopropylmethoxy)-1-piperidin-4-yl-1-azaspiro[3.5]nonan-2-one with MolForge

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Related Compounds

ethyl 2-[[4-[3-(cyclopropylmethoxy)-2-oxo-1-azaspiro[3.5]nonan-1-yl]piperidine-1-carbonyl]amino]acetate
CID 91925499
1-(cyclopropylmethoxy)spiro[3.5]nonan-3-one
CID 66367438
cyclopropylmethyl 1-piperidin-4-ylpyrrolidine-2-carboxylate
CID 61150843
1-(cyclohexylmethoxy)spiro[3.4]octan-3-one
CID 66368904
6,6-diamino-1-piperidin-4-yl-1,3-diazinane-2,4-dione
CID 91164049
3-(cyclohexylmethoxy)pyrrolidine
CID 45075453
1-piperidin-4-ylpyrrolidine-2,5-dione;hydrochloride
CID 20556253
3-(cyclopropylmethoxymethyl)-1-piperidin-4-ylpiperidine;dihydrochloride
CID 156735211
2-(2-piperidin-4-yloxyethyl)-2-azaspiro[3.6]decane
CID 79678043
1-(piperidin-4-yloxymethyl)cyclohexan-1-ol
CID 106939260
cyclopropylmethyl 3-methylpiperidine-3-carboxylate
CID 63134595
(5R)-1-piperidin-4-yl-7-oxa-1,3-diazaspiro[4.4]nonan-2-one
CID 99727914

Frequently Asked Questions

What is the IUPAC name of (3R)-3-(cyclopropylmethoxy)-1-piperidin-4-yl-1-azaspiro[3.5]nonan-2-one?
The IUPAC name of (3R)-3-(cyclopropylmethoxy)-1-piperidin-4-yl-1-azaspiro[3.5]nonan-2-one (CID 99728085) is (3R)-3-(cyclopropylmethoxy)-1-piperidin-4-yl-1-azaspiro[3.5]nonan-2-one.
What is the SMILES notation for (3R)-3-(cyclopropylmethoxy)-1-piperidin-4-yl-1-azaspiro[3.5]nonan-2-one?
The canonical SMILES for (3R)-3-(cyclopropylmethoxy)-1-piperidin-4-yl-1-azaspiro[3.5]nonan-2-one is O=C1[C@H](OCC2CC2)C2(CCCCC2)N1C1CCNCC1.
What is the InChIKey of (3R)-3-(cyclopropylmethoxy)-1-piperidin-4-yl-1-azaspiro[3.5]nonan-2-one?
The InChIKey is YNPAUOPLPOQNMZ-HNNXBMFYSA-N. The full InChI is InChI=1S/C17H28N2O2/c20-16-15(21-12-13-4-5-13)17(8-2-1-3-9-17)19(16)14-6-10-18-11-7-14/h13-15,18H,1-12H2/t15-/m0/s1.
What are the key properties of (3R)-3-(cyclopropylmethoxy)-1-piperidin-4-yl-1-azaspiro[3.5]nonan-2-one?
(3R)-3-(cyclopropylmethoxy)-1-piperidin-4-yl-1-azaspiro[3.5]nonan-2-one has a molecular weight of 292.42 g/mol, XLogP of 2.08, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-3-(cyclopropylmethoxy)-1-piperidin-4-yl-1-azaspiro[3.5]nonan-2-one is sourced from PubChem (CID 99728085), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).